N-[(5E)-4-oxidanylidene-5-[(4-phenethyloxyphenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-3-yl]adamantane-1-carboxamide

Systemtic Name: N-[(5E)-4-oxidanylidene-5-[(4-phenethyloxyphenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-3-yl]adamantane-1-carboxamide Openeye Name: N-[(5E)-4-oxo-5-[(4-phenethyloxyphenyl)methylene]-2-thioxo-thiazolidin-3-yl]adamantane-1-carboxamide CAS Name: N-[(5E)-4-oxo-5-[(4-phenethyloxyphenyl)methylidene]-2-sulfanylidene-3-thiazolidinyl]-1-adamantanecarboxamide IUPAC Name: N-[(5E)-4-oxo-5-[(4-phenethyloxyphenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-3-yl]adamantane-1-carboxamide Traditional Name: N-[(5E)-4-keto-5-(4-phenethyloxybenzylidene)-2-thioxo-thiazolidin-3-yl]adamantane-1-carboxamide Formula: C29H30N2O3S2 MolecularWeight: 518.6901

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C(=O)NN4C(=O)C(=CC5=CC=C(C=C5)OCCC6=CC=CC=C6)SC4=S

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C(=O)NN4C(=O)/C(=C\C5=CC=C(C=C5)OCCC6=CC=CC=C6)/SC4=S

InChI

InChI=1S/C29H30N2O3S2/c32-26-25(15-20-6-8-24(9-7-20)34-11-10-19-4-2-1-3-5-19)36-28(35)31(26)30-27(33)29-16-21-12-22(17-29)14-23(13-21)18-29/h1-9,15,21-23H,10-14,16-18H2,(H,30,33)/b25-15+